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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > sesquiterpenoid > melleolide n
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesquiterpenoid > melleolide n

Preferred term

melleolide n  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C23H29ClO6

inchi

  • InChI=1S/C23H29ClO6/c1-11-18(15(25)6-16(26)19(11)24)20(28)30-10-13-5-12-7-21(2,3)8-14(12)22(4)9-17(27)23(13,22)29/h5-6,12,14,17,25-27,29H,7-10H2,1-4H3/t12-,14+,17-,22-,23+/m1/s1

inchikey

  • LRJNLSGTPANDCI-PPUVGZBRSA-N

mass

  • 436.930

monoisotopicmass

  • 436.16527

smiles

  • ClC1=C(O)C=C(O)C(=C1C)C(=O)OCC2=C[C@H]3[C@H](CC(C3)(C)C)[C@@]4([C@@]2(O)[C@H](O)C4)C

subset

  • 2_STAR

synonym EXACT

  • [(2R,2aS,4aS,7aS,7bR)-2,2a-dihydroxy-6,6,7b-trimethyl-1,2,4a,5,7,7a-hexahydrocyclobuta[e]inden-3-yl]methyl 3-chloro-4,6-dihydroxy-2-methylbenzoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:209552

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